Chemical Properties of 2,3-DICHLOROBENZENETHIOL

2,3-DICHLOROBENZENETHIOL

InChI
InChI=1S/C6H4Cl2S/c7-4-2-1-3-5(9)6(4)8/h1-3,9H
InChI Key
QGRKONUHHGBHRB-UHFFFAOYSA-N
Formula
C6H4Cl2S
SMILES
Sc1cccc(Cl)c1Cl
Molecular Weight1
179.07
Other Names
  • 2,3-Dichlorothiophenol
  • Benzenethiol, 2,3-dichloro-
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
ω 0.3447 Relay (1.0) Calculated Property
ΔfG° 98.32 kJ/mol Joback Calculated Property
ΔfH°gas 32.63 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 17.00 kJ/mol Joback Calculated Property
ΔvapH° 56.10 kJ/mol Relay (1.0) Calculated Property
IE 8.49 eV Relay (1.0) Calculated Property
log10WS -3.46 Relay (1.0) Calculated Property
logPoct/wat 3.282 Crippen Calculated Property
McVol 112.470 ml/mol McGowan Calculated Property
Pc 4426.72 kPa Joback Calculated Property
Tboil 514.23 K Relay (1.0) Calculated Property
Tc 779.98 K Relay (1.0) Calculated Property
Tfus 305.62 K Relay (1.0) Calculated Property
Vc 0.379 m3/kmol Relay (1.0) Calculated Property

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [128.20; 246.18] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A3.28000e+01
Coefficient B4.16800e-01
Coefficient C-2.62920e-04
Coefficient D5.95000e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 128.20 J/mol×K 273.00 Calculated Property
Cp,gas 149.98 J/mol×K 353.78 Calculated Property
Cp,gas 169.16 J/mol×K 434.56 Calculated Property
Cp,gas 185.91 J/mol×K 515.33 Calculated Property
Cp,gas 200.43 J/mol×K 596.11 Calculated Property
Cp,gas 212.92 J/mol×K 676.89 Calculated Property
Cp,gas 223.54 J/mol×K 757.67 Calculated Property
Cp,gas 232.50 J/mol×K 838.44 Calculated Property
Cp,gas 239.99 J/mol×K 919.22 Calculated Property
Cp,gas 246.18 J/mol×K 1000.00 Calculated Property

Similar Compounds

Benzenethiol, 2-chloro-. Benzenethiol, 3-chloro-. Benzenethiol, 2,5-dichloro-. 4-Chloro-meta-benzenedithiol. Benzenethiol, 4-chloro-. 2-Chloro-4-fluorothiophenol. Benzene, 1-chloro-3-(phenylthio)-. 3-Chlorothioanisole. Benzene, 1,2,4-trichloro-5-[(4-chlorophenyl)thio]-. 2,3,4-Trichlorobenzenesulfonyl chloride. Benzenesulfonyl chloride, 3,4-dichloro-. 3-Chlorobenzenesulphonyl chloride. 2-Chlorobenzenesulfonyl chloride. Bis(3,4-dichlorophenylthio)methane. 2,4-Dichlorobenzenesulfonyl chloride.

Find more compounds similar to 2,3-DICHLOROBENZENETHIOL.

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
These property values are available through the Cheméo API. A free account gives you an access key.